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Information card for entry 4512459
Preview
| Coordinates | 4512459.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H42 Cl4 N6 Ni2 O8 S2 |
|---|---|
| Calculated formula | C30 H42 Cl4 N6 Ni2 O8 S2 |
| Title of publication | Dual Homogeneous and Heterogeneous Pathways in Photo- and Electrocatalytic Hydrogen Evolution with Nickel(II) Catalysts Bearing Tetradentate Macrocyclic Ligands |
| Authors of publication | Chen, Lingjing; Chen, Gui; Leung, Chi-Fai; Yiu, Shek-Man; Ko, Chi-Chiu; Anxolabéhère-Mallart, Elodie; Robert, Marc; Lau, Tai-Chu |
| Journal of publication | ACS Catalysis |
| Year of publication | 2015 |
| Journal volume | 5 |
| Journal issue | 1 |
| Pages of publication | 356 |
| a | 8.0156 ± 0.0005 Å |
| b | 12.2115 ± 0.0008 Å |
| c | 19.7215 ± 0.0012 Å |
| α | 91.373 ± 0.005° |
| β | 99.117 ± 0.005° |
| γ | 93.388 ± 0.005° |
| Cell volume | 1901.6 ± 0.2 Å3 |
| Cell temperature | 133 ± 2 K |
| Ambient diffraction temperature | 133 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.071 |
| Residual factor for significantly intense reflections | 0.0637 |
| Weighted residual factors for significantly intense reflections | 0.1661 |
| Weighted residual factors for all reflections included in the refinement | 0.1709 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.091 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179671 (current) | 2016-03-24 | cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/24. |
4512459.cif |
| 130414 | 2015-02-04 | cif/ Updating files of 4512457, 4512458, 4512459, 4512460 Original log message: Adding full bibliography for 4512457--4512460.cif. |
4512459.cif |
| 128579 | 2014-12-13 | cif/ Adding structures of 4512459 via cif-deposit CGI script. |
4512459.cif |
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Users of the data should acknowledge the original authors of the
structural data.